2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-pentyl-ethanamide

Systemtic Name: 2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-pentyl-ethanamide Openeye Name: 2-[3-(3,5-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-pentyl-acetamide CAS Name: 2-[[3-(3,5-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-N-pentylacetamide IUPAC Name: 2-[3-(3,5-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-pentylacetamide Traditional Name: N-amyl-2-[[3-(3,5-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC(=CC(=C3)C)C

Isomeric SMILES

CCCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC(=CC(=C3)C)C

InChI

InChI=1S/C23H27N3O2S/c1-4-5-8-11-24-21(27)15-29-23-25-20-10-7-6-9-19(20)22(28)26(23)18-13-16(2)12-17(3)14-18/h6-7,9-10,12-14H,4-5,8,11,15H2,1-3H3,(H,24,27)